C173H107N15 — CID 160685349
1-carbazol-9-yl-5-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;11-carbazol-9-yl-5-[4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-carbazol-9-yl-5-[5-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]benzo[b]carbazole (PubChem CID 160685349) has the molecular formula C173H107N15 and a molecular weight of 2395.86 g/mol. Its IUPAC name is 1-carbazol-9-yl-5-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;11-carbazol-9-yl-5-[4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-carbazol-9-yl-5-[5-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]benzo[b]carbazole.
| Compound Name | 1-carbazol-9-yl-5-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;11-carbazol-9-yl-5-[4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-carbazol-9-yl-5-[5-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]benzo[b]carbazole |
|---|---|
| PubChem CID | 160685349 |
| Molecular Formula | C173H107N15 |
| Molecular Weight | 2395.86 g/mol |
| Exact Mass | 2393.88 |
| IUPAC Name | 1-carbazol-9-yl-5-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;11-carbazol-9-yl-5-[4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-carbazol-9-yl-5-[5-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]benzo[b]carbazole |
| SMILES | c1ccc(-c2nc(-c3ccc4ccccc4c3)nc(-c3ccc(-n4c5cc6ccccc6cc5c5c(-n6c7ccccc7c7ccccc76)cccc54)c4ccccc34)n2)cc1.c1ccc(-c2nc(-c3cccc4ccccc34)nc(-c3ccc(-n4c5ccccc5c5c(-n6c7ccccc7c7ccccc76)c6ccccc6cc54)c4ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3-c3ccccc3)nc(-c3cccc4c(-n5c6ccccc6c6cc7c(-n8c9ccccc9c9ccccc98)cccc7cc65)cccc34)n2)cc1 |
| InChI | InChI=1S/C59H37N5.2C57H35N5/c1-3-18-38(19-4-1)41-23-7-8-27-47(41)58-60-57(39-20-5-2-6-21-39)61-59(62-58)48-30-16-29-43-42(48)28-17-35-54(43)64-53-33-14-11-26-46(53)50-37-49-40(36-56(50)64)22-15-34-55(49)63-51-31-12-9-24-44(51)45-25-10-13-32-52(45)63;1-2-18-37(19-3-1)55-58-56(45-29-16-21-36-17-4-6-22-39(36)45)60-57(59-55)46-33-34-51(42-25-9-8-24-41(42)46)61-50-32-15-12-28-47(50)53-52(61)35-38-20-5-7-23-40(38)54(53)62-48-30-13-10-26-43(48)44-27-11-14-31-49(44)62;1-2-16-37(17-3-1)55-58-56(41-30-29-36-15-4-5-18-38(36)33-41)60-57(59-55)46-31-32-50(43-22-9-8-21-42(43)46)62-52-28-14-27-51(54(52)47-34-39-19-6-7-20-40(39)35-53(47)62)61-48-25-12-10-23-44(48)45-24-11-13-26-49(45)61/h1-37H;2*1-35H |
| InChIKey | RORNXHRQRHXHCW-UHFFFAOYSA-N |
| XLogP | 44.09 |
| TPSA | 145.59 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 15 |
| Rotatable Bonds | 16 |
| Heavy Atoms | 188 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2395.86 |
| LogP ≤ 5 | 44.09 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 15 |